SCHEMBL21135682

SCHEMBL21135682

NC(=O)C(Cc1cc#ccc1)NC(=O)C(N)CCCCNP

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.42
▸ NPY1R P25929 8/20 0.42
▸ NPY2R P49146 6/20 0.42
▸ NPY5R Q15761 4/20 0.42
▸ IL1RN P18510 1/20 0.33
▸ ERAP2 Q6P179 1/20 0.33
▸ ERAP1 Q9NZ08 1/20 0.33
▸ CTSL P07711 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21135936 0.84 — —
SCHEMBL21135937 0.83 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RIL1RN
SCHEMBL21135676 0.83 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RIL1RN
SCHEMBL23153688 0.80 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5R
SCHEMBL21135807 0.77 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5RCTSL
SCHEMBL25865417 0.71 OPRK1 (0.51) NPY4RNPY1RNPY2RNPY5RIL1RN
SCHEMBL21135708 0.70 SLC7A5 (0.39) —
SCHEMBL23223604 0.69 MMP2 (0.63) IL1RNERAP2ERAP1CTSL
SCHEMBL30534073 0.69 MMP2 (0.63) IL1RNERAP2ERAP1CTSL
SCHEMBL23223538 0.69 MMP2 (0.63) IL1RNERAP2ERAP1CTSL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10961273-B2 N-carboxyanhydride-based-scale synthesis of elamipretide STEALTH BIOTHERAPEUTICS CORP. (MC) 2021-03-30 — — US disclosed
US-20190202861-A1 N-CARBOXYANHYDRIDE-BASED-SCALE SYNTHESIS OF ELAMIPRETIDE STEALTH BIOTHERAPEUTICS INC. 2019-07-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10961273-B2 N-carboxyanhydride-based-scale synthesis of elamipretide MTPN, TUFM, PDF NPY4R 358/4885NPY1R 792/4885NPY2R 1302/4885
US-20190202861-A1 N-CARBOXYANHYDRIDE-BASED-SCALE SYNTHESIS OF ELAMIPRETIDE MTPN, TUFM, PDF NPY4R 358/4885NPY1R 792/4885NPY2R 1302/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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